UCSF

ZINC36693473

Substance Information

In ZINC since Heavy atoms Benign functionality
November 12th, 2009 34 Yes

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

Physical Representations

Type pH range xlogP Des A‑Pol Apolar desolvation (kcal/mol) Des Pol Polar desolvation (kcal/mol) H Don H-bond donors H Acc H-bond acceptors Chg Net charge tPSA (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 1.85 0.63 -23.79 1 11 0 143 505.578 7
Hi High (pH 8-9.5) 1.92 -1.5 -54.31 0 11 -1 149 504.57 7

Activity (Go SEA)

Analogs ( Draw Identity 99% 90% 80% 70% )